SCHEMBL2652800

SCHEMBL2652800

COC(=O)c1c(-c2ccccc2)cnnc1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 3/20 1.00
GABRB3 P28472 3/20 1.00
GABRA5 P31644 3/20 1.00
GABRA3 P34903 3/20 1.00
GABRA1 P14867 2/20 1.00
PTGS1 P23219 1/20 0.51
ALDH1A1 P00352 3/20 0.50
HTT P42858 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 4/20 0.48
HPGD P15428 2/20 0.48
PRKCZ Q05513 1/20 0.48
TP53 P04637 3/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
THRB P10828 2/20 0.46
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PTBP1 P26599 1/20 0.43
DHODH Q02127 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29899479 1.00 GABRG2 (1.00) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL2652289 0.84 GABRA1 (0.72) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL6122459 0.84 GABRG2 (0.72) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL2653989 0.82 GABRA1 (0.69) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL29618008 0.82 GABRA1 (0.69) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL6121572 0.82 GABRA1 (0.69) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL8565250 0.81 GABRA5 (0.68) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL8534202 0.80 GABRA1 (0.66) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL8586468 0.80 GABRA1 (0.66) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL8534623 0.79 GABRA1 (0.65) GABRG2GABRB3GABRA5GABRA3GABRA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 80 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060235021-A1 Phenylpyridazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2006-10-19 US claimed
US-20260033761-A1 CHARACTERISATION OF NEUROLOGICAL DYSFUNCTION HOFFMANN LA ROCHE (US) 2026-02-05 US disclosed
US-12528819-B2 Benzodiazepine derivatives, compositions, and methods for treating cognitive impairment AGENEBIO, INC. (US) 2026-01-20 US disclosed
US-12291535-B2 Benzodiazepine derivatives, compositions, and methods for treating cognitive impairment AGENEBIO, INC. (US) 2025-05-06 US disclosed
US-12024525-B2 Benzodiazepine derivatives, compositions, and methods for treating cognitive impairment AGENEBIO, INC. (US) 2024-07-02 US disclosed
US-20240132513-A1 BENZAZEPINE DERIVATIVES, COMPOSITIONS, AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. 2024-04-25 US disclosed
CN-112601749-B Benzodiazepine derivatives, compositions and methods for treating cognitive impairment 艾吉因生物股份有限公司 2024-03-26 CN disclosed
WO-2024039886-A1 BENZAZEPINE DERIVATIVES, COMPOSITIONS, AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2024-02-22 WO disclosed
WO-2024023268-A1 CHARACTERISATION OF NEUROLOGICAL DYSFUNCTION F. HOFFMANN-LA ROCHE AG (CH) 2024-02-01 WO disclosed
CN-112409363-B Benzodiazepine derivatives, compositions and methods for the treatment of cognitive impairment 艾吉因生物股份有限公司 2023-11-14 CN disclosed
US-20130237545-A1 PYRIDAZINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2013-09-12 US disclosed
US-20130237545-A1 PYRIDAZINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2013-09-12 US disclosed
US-20130237530-A1 BENZODIAZEPINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2013-09-12 US disclosed
US-20130237545-A1 PYRIDAZINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2013-09-12 US disclosed
WO-2012068161-A1 PYRIDAZINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2012-05-24 WO disclosed
WO-2012068149-A1 BENZODIAZEPINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2012-05-24 WO disclosed
WO-2012068161-A1 PYRIDAZINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO, INC. (US) 2012-05-24 WO disclosed
US-20060235021-A1 Phenylpyridazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2006-10-19 US disclosed
EP-1532120-A1 PHENYLPYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LTD. (GB) 2005-05-25 EP disclosed
WO-2004014865-A1 PHENYLPYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2004-02-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060235021-A1 Phenylpyridazine derivatives as ligands for gaba receptors GABRA5, GABRA2, GABRA3 GABRG2 20/4885GABRB3 8/4885GABRA5 1/4885
US-20260033761-A1 CHARACTERISATION OF NEUROLOGICAL DYSFUNCTION PMP22, PARK7, NCS1 GABRG2 425/4885GABRB3 331/4885GABRA5 101/4885
US-20130237545-A1 PYRIDAZINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT GRM5, GRIK5, CHRNA5 GABRG2 52/4885GABRB3 62/4885GABRA5 4/4885
US-12024525-B2 Benzodiazepine derivatives, compositions, and methods for treating cognitive impairment GRM5, GABRA5, GABRE GABRG2 24/4885GABRB3 15/4885GABRA5 2/4885
US-12528819-B2 Benzodiazepine derivatives, compositions, and methods for treating cognitive impairment GABRA5, GRM5, GABRE GABRG2 20/4885GABRB3 11/4885GABRA5 1/4885
US-20130237530-A1 BENZODIAZEPINE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING COGNITIVE IMPAIRMENT GABRA5, GABRA3, GABRB3 GABRG2 12/4885GABRB3 3/4885GABRA5 1/4885
US-12291535-B2 Benzodiazepine derivatives, compositions, and methods for treating cognitive impairment GABRA5, GRM5, GABRA1 GABRG2 14/4885GABRB3 11/4885GABRA5 1/4885
US-20240132513-A1 BENZAZEPINE DERIVATIVES, COMPOSITIONS, AND METHODS FOR TREATING COGNITIVE IMPAIRMENT GABRA5, GRM5, GABRB1 GABRG2 20/4885GABRB3 7/4885GABRA5 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.